45E: 1-[4-(2,3-dimethoxybenzoyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone
45E is a Ligand Of Interest in 4X3T designated by the RCSB
| Best-fitted instance in this entry |
| Other instances in this entry |
| Identifier | Ranking for goodness of fit | Ranking for geometry | Real space R factor | Real space correlation coefficient | RMSZ-bond-length | RMSZ-bond-angle | Outliers of bond length | Outliers of bond angle | Atomic clashes | Stereochemical errors | Model completeness | Average occupancy |
|---|
| 4X3T_45E_A_101 | 83% | 43% | 0.099 | 0.958 | 0.78 | 1.47 | - | 5 | 2 | 0 | 100% | 1 |
| 4X3T_45E_B_101 | 76% | 49% | 0.131 | 0.969 | 0.76 | 1.21 | - | 3 | 0 | 0 | 100% | 1 |
| 4X3T_45E_D_101 | 68% | 35% | 0.145 | 0.957 | 1.1 | 1.53 | 3 | 8 | 3 | 0 | 100% | 1 |
| 4X3T_45E_E_101 | 64% | 44% | 0.143 | 0.942 | 0.89 | 1.31 | 1 | 7 | 0 | 0 | 100% | 1 |
| 4X3T_45E_F_101 | 63% | 36% | 0.123 | 0.92 | 0.92 | 1.65 | 1 | 9 | 2 | 0 | 100% | 1 |
| 4X3T_45E_C_101 | 51% | 40% | 0.158 | 0.912 | 0.64 | 1.72 | - | 8 | 2 | 0 | 100% | 1 |
